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Name | CHEMBL1915866 |
---|---|
Molecular formula | C25H20Cl2F2N2O5 |
IUPAC name | 2-[4-chloro-3-[[2-chloro-4-[[(2S)-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl]methoxy]benzoyl]amino]phenyl]-2,2-difluoroacetic acid |
Molecular weight | 537.341 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 2 |
XlogP | 5.8 |
Synonyms | BDBM50357636 SCHEMBL730099 |
Inchi Key | AWGFVNBSZWQCDL-INIZCTEOSA-N |
Inchi ID | InChI=1S/C25H20Cl2F2N2O5/c1-31-12-16(36-22-5-3-2-4-21(22)31)13-35-15-7-8-17(19(27)11-15)23(32)30-20-10-14(6-9-18(20)26)25(28,29)24(33)34/h2-11,16H,12-13H2,1H3,(H,30,32)(H,33,34)/t16-/m0/s1 |
PubChem CID | 57401554 |
ChEMBL | CHEMBL1915866 |
IUPHAR | N/A |
BindingDB | 50357636 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
15993 | Prostacyclin receptor | P43119 | PTGIR | Homo sapiens (Human) | 386 |
15994 | Prostaglandin D2 receptor | P70263 | Ptgdr | Mus musculus (Mouse) | 357 |
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